Is inhibition process better described with MD(QM/MM) simulations? The case of urokinase type plasminogen activator inhibitors

Florent Barbault, François Maurel. Is inhibition process better described with MD(QM/MM) simulations? The case of urokinase type plasminogen activator inhibitors. Journal of Computational Chemistry, 33(6):607-616, 2012. [doi]

Abstract

Abstract is missing.